Vitas-M small molecule compound

2-{1-[(2-methoxyphenyl)amino]ethylidene}-5-phenylcyclohexane-1,3-dione

Catalog ID
STK836331
SMILES COc1ccccc1N/C(=C\1/C(=O)CC(CC1=O)c1ccccc1)/C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H21NO3 MW 335.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO3/c1-14(22-17-10-6-7-11-20(17)25-2)21-18(23)12-16(13-19(21)24)15-8-4-3-5-9-15/h3-11,16,22H,12-13H2,1-2H3/b21-14-
InChIKey
VBDYUYVCODLQFF-STZFKDTASA-N
Synonyms

2(1((2methoxyphenyl)amino)ethylidene)5phenylcyclohexane13dione
COc1ccccc1NC(=C1C(=O)CC(CC1=O)c1ccccc1)C
MFCD02162591
ZINC000100557683

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.